(14R)-Grayanotoxane-3beta,5,6beta,7alpha,10,14,16-Heptol
[CAS# 56663-60-6]

Identification

• Name: (14R)-Grayanotoxane-3beta,5,6beta,7alpha,10,14,16-Heptol
• Synonyms: Bisdeacylasebotoxin V; Deacylpieristoxin F; Grayanotoxane-3,5,6,7,10,14,16-Heptol, (3-Beta,6-Beta,7-Alpha,14R)- (9Ci)
• Molecular Formula: C₂₀H₃₄O₇
• Molecular Weight: 386.48
• CAS Registry Number: 56663-60-6
• SMILES: CC2(C1(C(C(C34C(C(C1CC2O)(O)C)CCC(C3O)C(C4)(O)C)O)O)O)C
• InChI: 1S/C20H34O7/c1-16(2)12(21)7-11-18(4,26)10-6-5-9-13(22)19(10,8-17(9,3)25)14(23)15(24)20(11,16)27/h9-15,21-27H,5-8H2,1-4H3
• InChIKey: HRJZZHMMTOORSG-UHFFFAOYSA-N

Properties

• Density: 1.43g/cm³ (Cal.)
• Boiling point: 572.951°C at 760 mmHg (Cal.)
• Flash point: 259.833°C (Cal.)